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sodium 4-(1,1-diphenylpropoxy)-4-oxidanylidene-3-sulfo-butanoate

sodium 4-(1,1-diphenylpropoxy)-4-oxidanylidene-3-sulfo-butanoate

Systemtic Name:sodium 4-(1,1-diphenylpropoxy)-4-oxidanylidene-3-sulfo-butanoate
Openeye Name:sodium 4-(1,1-diphenylpropoxy)-4-oxo-3-sulfo-butanoate
CAS Name:sodium 4-(1,1-diphenylpropoxy)-4-oxo-3-sulfobutanoate
IUPAC Name:sodium 4-(1,1-diphenylpropoxy)-4-oxo-3-sulfobutanoate
Traditional Name:sodium 4-(1,1-diphenylpropoxy)-4-keto-3-sulfo-butyrate
Formula: C19H19NaO7S
MolecularWeight: 414.40473
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)C(CC(=O)[O-])S(=O)(=O)O.[Na+]


Isomeric SMILES

CCC(C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)C(CC(=O)[O-])S(=O)(=O)O.[Na+]


InChI

InChI=1S/C19H20O7S.Na/c1-2-19(14-9-5-3-6-10-14,15-11-7-4-8-12-15)26-18(22)16(13-17(20)21)27(23,24)25;/h3-12,16H,2,13H2,1H3,(H,20,21)(H,23,24,25);/q;+1/p-1


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